General Information of the Compound
| Compound ID |
CP0379027
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| Compound Name |
4-(4-chlorophenyl)-1-[1-(2,6-dichlorophenyl)sulfonyl-4-methylpiperidin-4-yl]piperidin-4-ol
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| Structure |
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| Formula |
C23H27Cl3N2O3S
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| Molecular Weight |
517.906
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| Canonical SMILES |
CC1(CCN(CC1)S(=O)(=O)c1c(Cl)cccc1Cl)N1CCC(O)(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H27Cl3N2O3S/c1-22(27-13-11-23(29,12-14-27)17-5-7-18(24)8-6-17)9-15-28(16-10-22)32(30,31)21-19(25)3-2-4-20(21)26/h2-8,29H,9-16H2,1H3
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| InChIKey |
OCGBVLQLCRQMAB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound